2,4,4-tris(chloranyl)-3-[(2,6-ditert-butylthiopyran-4-ylidene)methyl]cyclobut-2-en-1-one

Systemtic Name: 2,4,4-tris(chloranyl)-3-[(2,6-ditert-butylthiopyran-4-ylidene)methyl]cyclobut-2-en-1-one Openeye Name: 2,4,4-trichloro-3-[(2,6-ditert-butylthiopyran-4-ylidene)methyl]cyclobut-2-en-1-one CAS Name: 2,4,4-trichloro-3-[(2,6-ditert-butyl-4-thiopyranylidene)methyl]-1-cyclobut-2-enone IUPAC Name: 2,4,4-trichloro-3-[(2,6-ditert-butylthiopyran-4-ylidene)methyl]cyclobut-2-en-1-one Traditional Name: 2,4,4-trichloro-3-[(2,6-ditert-butylthiopyran-4-ylidene)methyl]cyclobut-2-en-1-one Formula: C18H21Cl3OS MolecularWeight: 391.78274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC2=C(C(=O)C2(Cl)Cl)Cl)C=C(S1)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC2=C(C(=O)C2(Cl)Cl)Cl)C=C(S1)C(C)(C)C

InChI

InChI=1S/C18H21Cl3OS/c1-16(2,3)12-8-10(9-13(23-12)17(4,5)6)7-11-14(19)15(22)18(11,20)21/h7-9H,1-6H3